Vitas-M small molecule compound

N-[2-(2-{(Z)-[1-(4-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-3-yl)ethyl]acetamide

Catalog ID
STL047308
SMILES CC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)c2ccc(cc2)C)S)[nH]c2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H22N4O3S MW 446.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3S/c1-14-7-9-16(10-8-14)28-23(31)19(22(30)27-24(28)32)13-21-18(11-12-25-15(2)29)17-5-3-4-6-20(17)26-21/h3-10,13,26H,11-12H2,1-2H3,(H,25,29)(H,27,30,32)/b19-13-
InChIKey
ORZXSLNSAKCWGR-UYRXBGFRSA-N
Synonyms

CC(=O)NCCc1c(C=C2C(=O)N=C(N(C2=O)c2ccc(cc2)C)S)(nH)c2c1cccc2
MFCD04072683
ZINC000009185491

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.